3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol

C12H12N4O — CID 136985848

IUPAC3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol
SMILESCn1nc(N)cc1-c1c[nH]c2c(O)cccc12
InChIInChI=1S/C12H12N4O/c1-16-9(5-11(13)15-16)8-6-14-12-7(8)3-2-4-10(12)17/h2-6,14,17H,1H3,(H2,13,15)
InChIKeyDZYBPXIGOARJMF-UHFFFAOYSA-N
MW228.26 g/mol
LogP1.86
Rot. Bonds1

About 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol

3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol (PubChem CID 136985848) has the molecular formula C12H12N4O and a molecular weight of 228.26 g/mol. Its IUPAC name is 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol.

Molecular Properties

Compound Name3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol
PubChem CID136985848
Molecular FormulaC12H12N4O
Molecular Weight228.26 g/mol
Exact Mass228.10
IUPAC Name3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol
SMILESCn1nc(N)cc1-c1c[nH]c2c(O)cccc12
InChIInChI=1S/C12H12N4O/c1-16-9(5-11(13)15-16)8-6-14-12-7(8)3-2-4-10(12)17/h2-6,14,17H,1H3,(H2,13,15)
InChIKeyDZYBPXIGOARJMF-UHFFFAOYSA-N
XLogP1.86
TPSA79.86 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.26
LogP ≤ 51.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-6-ol
CID 136985875
3-(3-amino-1H-pyrazol-5-yl)-1H-indol-7-ol
CID 136985847
3-(5-amino-1,2-oxazol-3-yl)-1H-indol-7-ol
CID 136985951
5-(1H-indol-3-yl)-N,1-dimethylpyrazol-3-amine
CID 136995821
5-(4-methoxy-1-methylindol-3-yl)-1-methylpyrazol-3-amine
CID 115108341
1-methyl-5-(4-methyl-1-benzothiophen-2-yl)pyrazol-3-amine
CID 115110015
2-(3-amino-1-methylpyrazol-5-yl)-1H-indol-6-ol
CID 136985765
2-methyl-6-(7-methyl-1H-indol-3-yl)pyridin-3-ol
CID 162628575
4-(7-hydroxy-1H-indol-3-yl)-1H-imidazole-5-carboxylic acid
CID 82386558
1-methyl-5-(6-methyl-1H-indol-3-yl)pyrazole-3-carboxylic acid
CID 136985862
5-(7-hydroxy-1H-indol-3-yl)-1,2-oxazole-4-carboxylic acid
CID 136986177
5-(7-methoxy-1H-indol-3-yl)-1-methylpyrrole-2-carboxylic acid
CID 115110289

Frequently Asked Questions

What is the IUPAC name of 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol?
The IUPAC name of 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol (CID 136985848) is 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol.
What is the SMILES notation for 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol?
The canonical SMILES for 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol is Cn1nc(N)cc1-c1c[nH]c2c(O)cccc12.
What is the InChIKey of 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol?
The InChIKey is DZYBPXIGOARJMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O/c1-16-9(5-11(13)15-16)8-6-14-12-7(8)3-2-4-10(12)17/h2-6,14,17H,1H3,(H2,13,15).
What are the key properties of 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol?
3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol has a molecular weight of 228.26 g/mol, XLogP of 1.86, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-amino-1-methylpyrazol-5-yl)-1H-indol-7-ol is sourced from PubChem (CID 136985848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).